Vitas-M small molecule compound
methyl 2-({2-[(chloroacetyl)amino]-3-ethoxy-1,1,1-trifluoro-3-oxopropan-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK537159
SMILES CCOC(=O)C(C(F)(F)F)(Nc1sc2c(c1C(=O)OC)CCCC2)NC(=O)CCl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H20ClF3N2O5S MW 456.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20ClF3N2O5S/c1-3-28-15(26)16(17(19,20)21,22-11(24)8-18)23-13-12(14(25)27-2)9-6-4-5-7-10(9)29-13/h23H,3-8H2,1-2H3,(H,22,24)InChIKey
ACACGTVEHDYYRD-UHFFFAOYSA-NSynonyms
CCOC(=O)C(C(F)(F)F)(NC1=C(C2=C(S1)CCCC2)C(=O)OC)NC(=O)CCl
InChI=1SC17H20ClF3N2O5Sc132815(26)16(17(1920)212211(24)818)231312(14(25)272)9645710(9)2913h23H38H212H3(H2224)
methyl2((2((2chloroacetyl)amino)3ethoxy111trifluoro3oxopropan2yl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2((chloroacetyl)amino)3ethoxy111trifluoro3oxopropan2yl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2(2chloroacetamido)3ethoxy111trifluoro3oxopropan2yl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
MFCD02933842
ZINC000002354935
ZINC000002354937
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